Crystallography Open Database

Information card for entry 7248569

Preview

Coordinates	7248569.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C84 H94 F4 N12 O25
Calculated formula	C84 H94 F4 N12 O25
Title of publication	Ciprofloxacin salts of benzene mono/di-carboxylate: Crystal structures and the improvement of solubility
Authors of publication	Zhu, Yujun; Liu, Ruoxi; Wang, Leyao; Chen, Chen; Zhao, Yupei; Guo, Wei; Zhang, Zhi-Hui
Journal of publication	CrystEngComm
Year of publication	2024
a	10.5368 ± 0.0012 Å
b	13.7042 ± 0.0016 Å
c	15.0079 ± 0.0017 Å
α	84.737 ± 0.002°
β	86.232 ± 0.002°
γ	69.254 ± 0.002°
Cell volume	2016.8 ± 0.4 Å³
Cell temperature	295 ± 2 K
Ambient diffraction temperature	295.15 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0869
Residual factor for significantly intense reflections	0.061
Weighted residual factors for significantly intense reflections	0.1872
Weighted residual factors for all reflections included in the refinement	0.2345
Goodness-of-fit parameter for all reflections included in the refinement	1.052
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7248569.html